B5GPS8 -OEChem-04012117252D 44 46 0 0 0 0 0 0 0999 V2000 9.3979 -2.4511 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7527 -1.9095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 2.6467 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3991 -0.2139 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0022 -0.3472 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3364 2.0589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0274 1.1078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7183 2.0589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0274 1.1078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 3.6467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7123 0.3231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3518 2.2911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7029 2.2911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3424 0.3231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7328 0.5318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0547 1.5224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6613 4.1467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3219 0.5318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3780 -0.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0443 -0.7555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7316 -1.7054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0232 -0.5514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0852 -3.4009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7515 -4.1467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1379 3.5390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7394 4.2293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5139 -0.2643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5365 2.8830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5182 2.8830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5408 -0.2643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6607 1.6537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9713 4.6836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1244 4.4567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3513 3.6097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 1.6537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9088 0.0694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2052 -0.8028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5719 0.5791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5389 -3.1078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7016 -3.8880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2891 -4.5597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1645 -4.6090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2138 -3.7336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 24 1 0 0 0 0 2 22 2 0 0 0 0 3 6 1 0 0 0 0 3 8 1 0 0 0 0 3 10 1 0 0 0 0 4 15 1 0 0 0 0 4 20 1 0 0 0 0 4 38 1 0 0 0 0 5 23 3 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 14 2 0 0 0 0 10 17 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 15 2 0 0 0 0 11 28 1 0 0 0 0 12 16 2 0 0 0 0 12 29 1 0 0 0 0 13 18 1 0 0 0 0 13 30 1 0 0 0 0 14 19 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END $$$$